SCHEMBL2560657

SCHEMBL2560657

Cc1cc(C)nc(-n2nc(C)c(C=O)c2Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 6/20 0.39
LMNA P02545 5/20 0.39
ALDH1A1 P00352 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HIF1A Q16665 1/20 0.39
MAPT P10636 2/20 0.38
THRB P10828 1/20 0.38
MAPK1 P28482 1/20 0.37
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2558416 0.82 HTT (0.38) HTTTSHRALDH1A1THRB
SCHEMBL2558134 0.82 HTT (0.38) HTTKDM4ETSHRSMN1; SMN2LMNA
SCHEMBL15332386 0.82 POLB (0.50) HTTSMN1; SMN2LMNAALDH1A1NPSR1
SCHEMBL2556856 0.81 KDM4E (0.41) HTTKDM4ETSHRSMN1; SMN2LMNA
SCHEMBL2562728 0.80 HTT (0.36) HTTTSHRSMN1; SMN2LMNAALDH1A1
SCHEMBL29952980 0.79 HTT (0.42) HTTSMN1; SMN2LMNAALDH1A1NPSR1
SCHEMBL2560133 0.79 HTT (0.35) HTTTSHRSMN1; SMN2LMNAALDH1A1
SCHEMBL15331834 0.75 SMN1; SMN2 (0.43) HTTKDM4ESMN1; SMN2LMNAALDH1A1
SCHEMBL2553164 0.74 MAPT (0.36) HTTKDM4ESMN1; SMN2LMNAALDH1A1
SCHEMBL15329916 0.74 HTT (0.36) HTTKDM4ESMN1; SMN2LMNAALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed